CHEMBRIDGE-ZINC04980945 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 0.8440 1.3830 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -0.0700 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -0.5290 1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -1.8560 1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -2.7420 0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -2.3270 -0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -0.9620 -1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -0.4480 -2.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -3.2740 -1.7440 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -3.6300 -2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -3.8480 -4.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 -4.2170 -3.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -4.0310 -1.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -5.1780 -5.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -6.4940 -5.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 -6.7490 -6.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9640 -5.8220 -7.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8730 -6.1210 -8.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 -7.3580 -8.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 -8.2980 -7.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -8.0140 -6.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 -8.9910 -5.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 -8.7560 -4.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -7.5250 -4.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 -7.2900 -3.7130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 1.4870 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 1.9260 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 1.8570 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 0.1510 2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -2.2030 2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 -3.7850 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -0.4730 -2.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -1.0350 -3.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 0.5780 -2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 -2.8750 -2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 -4.5570 -2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -2.9100 -4.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -4.3110 -4.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 -4.9190 -3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 -3.2630 -3.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -5.0120 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 -3.5260 -1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -5.2750 -6.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 -4.3340 -5.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -4.8400 -7.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0870 -5.3850 -9.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2070 -7.5950 -9.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7140 -9.2650 -7.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -9.9610 -5.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 -9.5420 -4.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -8.1300 -3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -4.7760 -4.1210 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3500 -5.6820 -3.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 11 52 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 52 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 25 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END